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CHEBI:93977 - 2-[2-(1,3-benzothiazol-2-ylsulfonyl)ethylthio]-4,6-dimethyl-3-pyridinecarbonitrile

ChEBI IDCHEBI:93977
ChEBI Name2-[2-(1,3-benzothiazol-2-ylsulfonyl)ethylthio]-4,6-dimethyl-3-pyridinecarbonitrile
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FormulaC17H15N3O2S3
Net Charge0
Average Mass389.527
Monoisotopic Mass389.03264
SMILESCc1cc(C)c(C#N)c(SCCS(=O)(=O)c2nc3ccccc3s2)n1
InChIInChI=1S/C17H15N3O2S3/c1-11-9-12(2)19-16(13(11)10-18)23-7-8-25(21,22)17-20-14-5-3-4-6-15(14)24-17/h3-6,9H,7-8H2,1-2H3
InChIKeyXMKRPODAKCRUFA-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
2-[2-(1,3-benzothiazol-2-ylsulfonyl)ethylthio]-4,6-dimethyl-3-pyridinecarbonitrile (CHEBI:93977) is a benzothiazoles (CHEBI:37947)
Manual XrefsDatabases
LSM-4562LINCS